[cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine

C16H24N2O — CID 105233788

IUPAC[cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine
SMILESNNC(C1CCCCC1)C1CCOc2ccccc21
InChIInChI=1S/C16H24N2O/c17-18-16(12-6-2-1-3-7-12)14-10-11-19-15-9-5-4-8-13(14)15/h4-5,8-9,12,14,16,18H,1-3,6-7,10-11,17H2
InChIKeyXKNQJTJNBMLCQJ-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.96
Rot. Bonds3

About [cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine

[cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine (PubChem CID 105233788) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is [cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine
PubChem CID105233788
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name[cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine
SMILESNNC(C1CCCCC1)C1CCOc2ccccc21
InChIInChI=1S/C16H24N2O/c17-18-16(12-6-2-1-3-7-12)14-10-11-19-15-9-5-4-8-13(14)15/h4-5,8-9,12,14,16,18H,1-3,6-7,10-11,17H2
InChIKeyXKNQJTJNBMLCQJ-UHFFFAOYSA-N
XLogP2.96
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine?
The IUPAC name of [cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine (CID 105233788) is [cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine.
What is the SMILES notation for [cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine?
The canonical SMILES for [cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine is NNC(C1CCCCC1)C1CCOc2ccccc21.
What is the InChIKey of [cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine?
The InChIKey is XKNQJTJNBMLCQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c17-18-16(12-6-2-1-3-7-12)14-10-11-19-15-9-5-4-8-13(14)15/h4-5,8-9,12,14,16,18H,1-3,6-7,10-11,17H2.
What are the key properties of [cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine?
[cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine has a molecular weight of 260.38 g/mol, XLogP of 2.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine is sourced from PubChem (CID 105233788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).